SIMILAR PATTERNS OF AMINO ACIDS FOR 4RFQ_A_SAMA401

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3be5 PUTATIVE IRON
COMPOUND-BINDING
PROTEIN OF ABC
TRANSPORTER FAMILY

(Escherichia
coli) 		PF01497
(Peripla_BP_2) 		5 PRO A  52
GLU A  55
ILE A 288
GLN A 168
TYR A 145
 None
 1.22A 4rfqA-3be5A:
1.3		 4rfqA-3be5A:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3exh PYRUVATE
DEHYDROGENASE E1
COMPONENT SUBUNIT
BETA, MITOCHONDRIAL

(Homo sapiens) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 GLU B 171
PRO B 117
ILE B 193
GLU B 173
TYR B  37
 None
 1.28A 4rfqA-3exhB:
0.0		 4rfqA-3exhB:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nyo G PROTEIN-COUPLED
RECEPTOR KINASE 6

(Homo sapiens) 		PF00069
(Pkinase)
PF00615
(RGS) 		5 GLU A 377
PRO A 384
ILE A 325
TYR A 376
TYR A 351
 None
 1.37A 4rfqA-3nyoA:
0.0		 4rfqA-3nyoA:
18.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l1n CONSERVED
LIPOPROTEIN,
PUTATIVE

(Clostridium
novyi) 		PF15525
(DUF4652) 		5 PRO A  97
GLU A 116
ILE A 132
GLU A 124
THR A 101
 None
 1.31A 4rfqA-4l1nA:
0.0		 4rfqA-4l1nA:
23.51
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4rfq HISTIDINE PROTEIN
METHYLTRANSFERASE 1
HOMOLOG

(Homo sapiens) 		PF13489
(Methyltransf_23) 		12 PRO A  78
GLU A  89
PRO A  90
ILE A 168
TRP A 169
GLN A 216
TYR A 218
GLU A 269
TRP A 270
THR A 295
TYR A 297
TYR A 301
 SAM  A 401 (-4.4A)
SAM  A 401 (-3.3A)
SAM  A 401 (-4.4A)
SAM  A 401 (-4.6A)
SAM  A 401 (-3.5A)
SAM  A 401 (-3.5A)
None
SAM  A 401 (-4.0A)
SAM  A 401 (-3.2A)
SAM  A 401 (-4.6A)
None
SAM  A 401 (-3.5A)
 0.00A 4rfqA-4rfqA:
49.6		 4rfqA-4rfqA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tnb G PROTEIN-COUPLED
RECEPTOR KINASE 5

(Homo sapiens) 		PF00069
(Pkinase)
PF00615
(RGS) 		5 GLU A 377
PRO A 384
ILE A 325
TYR A 376
GLU A 406
 None
 1.43A 4rfqA-4tnbA:
0.0		 4rfqA-4tnbA:
18.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tnb G PROTEIN-COUPLED
RECEPTOR KINASE 5

(Homo sapiens) 		PF00069
(Pkinase)
PF00615
(RGS) 		5 GLU A 377
PRO A 384
ILE A 325
TYR A 376
TYR A 351
 None
 1.41A 4rfqA-4tnbA:
0.0		 4rfqA-4tnbA:
18.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zaa FDC1

(Aspergillus
niger) 		PF01977
(UbiD) 		5 PRO A 189
ILE A 227
GLU A 282
THR A 395
TYR A 394
 None
None
CO2  A 608 ( 4.8A)
4M4  A 606 (-4.3A)
4M4  A 606 (-3.4A)
 1.22A 4rfqA-4zaaA:
0.0		 4rfqA-4zaaA:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5z06 BDI_3064 PROTEIN

(Parabacteroides
distasonis) 		no annotation 5 PRO A 120
ILE A  87
GLU A 112
THR A  74
TYR A  75
 None
 1.37A 4rfqA-5z06A:
0.0		 4rfqA-5z06A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1apy ASPARTYLGLUCOSAMINID
ASE

(Homo sapiens) 		PF01112
(Asparaginase_2) 		4 THR B 201
GLY B 237
ASP B 238
SER B 215
 None
 1.11A 4rfqA-1apyB:
undetectable		 4rfqA-1apyB:
16.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1b5f PROTEIN (CARDOSIN A)
PROTEIN (CARDOSIN A)

(Cynara
cardunculus;
Cynara
cardunculus) 		PF00026
(Asp)
PF00026
(Asp) 		4 THR B 287
GLY B 302
ASP B 303
SER A 222
 None
 0.92A 4rfqA-1b5fB:
undetectable		 4rfqA-1b5fB:
16.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1eyx R-PHYCOERYTHRIN

(Gracilaria
chilensis) 		PF00502
(Phycobilisome) 		4 THR A   6
GLY A 103
ASP A 106
SER A   3
 None
 1.25A 4rfqA-1eyxA:
undetectable		 4rfqA-1eyxA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1g01 ENDOGLUCANASE

(Bacillus sp.
KSM-635) 		PF00150
(Cellulase)
PF03424
(CBM_17_28) 		4 THR A 522
GLY A 493
ASP A 494
SER A 520
 None
 1.31A 4rfqA-1g01A:
undetectable		 4rfqA-1g01A:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1htq GLUTAMINE SYNTHETASE

(Mycobacterium
tuberculosis) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		4 THR A 315
GLY A  26
ASP A  23
SER A 364
 None
 1.39A 4rfqA-1htqA:
undetectable		 4rfqA-1htqA:
18.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1iom CITRATE SYNTHASE

(Thermus
thermophilus) 		PF00285
(Citrate_synt) 		4 THR A  47
GLY A 121
ASP A 123
SER A 339
 None
 1.17A 4rfqA-1iomA:
undetectable		 4rfqA-1iomA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1itz TRANSKETOLASE

(Zea mays) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 THR A 206
GLY A 167
ASP A 196
SER A 201
 None
TPP  A1002 ( 3.9A)
None
None
 1.40A 4rfqA-1itzA:
1.8		 4rfqA-1itzA:
17.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1iu4 MICROBIAL
TRANSGLUTAMINASE

(Streptomyces
mobaraensis) 		PF09017
(Transglut_prok) 		4 THR A 177
GLY A 186
ASP A 189
SER A 179
 None
 1.36A 4rfqA-1iu4A:
undetectable		 4rfqA-1iu4A:
21.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ivh ISOVALERYL-COA
DEHYDROGENASE

(Homo sapiens) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 THR A 168
GLY A  91
ASP A 367
SER A  96
 FAD  A 399 (-4.0A)
None
None
None
 1.26A 4rfqA-1ivhA:
undetectable		 4rfqA-1ivhA:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1knb ADENOVIRUS TYPE 5
FIBER PROTEIN

(Human
mastadenovirus
C) 		PF00541
(Adeno_knob) 		4 THR A 451
GLY A 443
ASP A 418
SER A 449
 None
 1.22A 4rfqA-1knbA:
undetectable		 4rfqA-1knbA:
19.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kv9 TYPE II
QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Pseudomonas
putida) 		PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3) 		4 THR A 507
GLY A 469
ASP A  37
SER A  31
 None
 1.06A 4rfqA-1kv9A:
undetectable		 4rfqA-1kv9A:
17.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lia R-PHYCOERYTHRIN

(Polysiphonia
urceolata) 		PF00502
(Phycobilisome) 		4 THR A   6
GLY A 105
ASP A 108
SER A   3
 None
 1.19A 4rfqA-1liaA:
undetectable		 4rfqA-1liaA:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		4 THR A 172
GLY A 141
ASP A 142
SER A 169
 None
 1.38A 4rfqA-1ofeA:
2.4		 4rfqA-1ofeA:
11.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pvx PROTEIN
(ENDO-1,4-BETA-XYLAN
ASE)

(Byssochlamys
spectabilis) 		PF00457
(Glyco_hydro_11) 		4 THR A  71
GLY A  43
ASP A  20
SER A 182
 None
 1.22A 4rfqA-1pvxA:
undetectable		 4rfqA-1pvxA:
19.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pxz MAJOR POLLEN
ALLERGEN JUN A 1

(Juniperus ashei) 		PF00544
(Pec_lyase_C) 		4 THR A 128
GLY A 174
ASP A 177
SER A 172
 None
 1.37A 4rfqA-1pxzA:
undetectable		 4rfqA-1pxzA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rp1 PANCREATIC LIPASE
RELATED PROTEIN 1

(Canis lupus) 		PF00151
(Lipase)
PF01477
(PLAT) 		4 THR A 115
GLY A 250
ASP A 247
SER A 113
 None
 1.11A 4rfqA-1rp1A:
undetectable		 4rfqA-1rp1A:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sb3 4-HYDROXYBENZOYL-COA
REDUCTASE ALPHA
SUBUNIT

(Thauera
aromatica) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		4 THR A 448
GLY A 519
ASP A 517
SER A 522
 None
 1.24A 4rfqA-1sb3A:
undetectable		 4rfqA-1sb3A:
16.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1te1 ENDO-1,4-XYLANASE

(Talaromyces
funiculosus) 		PF00457
(Glyco_hydro_11) 		4 THR B 185
GLY B  30
ASP B  31
SER B  36
 None
 1.32A 4rfqA-1te1B:
undetectable		 4rfqA-1te1B:
18.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xap RETINOIC ACID
RECEPTOR BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		4 THR A 203
GLY A 216
ASP A 219
SER A 205
 None
 1.36A 4rfqA-1xapA:
undetectable		 4rfqA-1xapA:
21.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xyz 1,4-BETA-D-XYLAN-XYL
ANOHYDROLASE

(Ruminiclostridium
thermocellum) 		PF00331
(Glyco_hydro_10) 		4 THR A 791
GLY A 717
ASP A 716
SER A 751
 None
 1.40A 4rfqA-1xyzA:
undetectable		 4rfqA-1xyzA:
21.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1y5e MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
B

(Bacillus cereus) 		PF00994
(MoCF_biosynth) 		4 THR A  24
GLY A  81
ASP A  88
SER A  22
 None
 1.29A 4rfqA-1y5eA:
3.3		 4rfqA-1y5eA:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ydo HMG-COA LYASE

(Bacillus
subtilis) 		PF00682
(HMGL-like) 		4 THR A 211
GLY A 238
ASP A  16
SER A 247
 None
 1.29A 4rfqA-1ydoA:
undetectable		 4rfqA-1ydoA:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z7z INTERCELLULAR
ADHESION MOLECULE-1

(Homo sapiens) 		PF03921
(ICAM_N) 		4 THR I  23
GLY I  72
ASP I  71
SER I  67
 None
 1.31A 4rfqA-1z7zI:
undetectable		 4rfqA-1z7zI:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a70 EMP47P

(Saccharomyces
cerevisiae) 		PF03388
(Lectin_leg-like) 		4 THR A  47
GLY A 207
ASP A  84
SER A  52
 None
 1.32A 4rfqA-2a70A:
undetectable		 4rfqA-2a70A:
23.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c1c CARBOXYPEPTIDASE B

(Helicoverpa zea) 		PF00246
(Peptidase_M14) 		4 THR A 194
GLY A 143
ASP A 142
SER A 254
 None
 1.31A 4rfqA-2c1cA:
undetectable		 4rfqA-2c1cA:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c2q G/U
MISMATCH-SPECIFIC
DNA GLYCOSYLASE

(Deinococcus
radiodurans) 		PF03167
(UDG) 		4 THR A 160
GLY A  32
ASP A  84
SER A 159
 None
ACT  A1190 ( 3.8A)
ACT  A1190 (-2.7A)
None
 1.28A 4rfqA-2c2qA:
undetectable		 4rfqA-2c2qA:
21.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cw6 HYDROXYMETHYLGLUTARY
L-COA LYASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00682
(HMGL-like) 		4 THR A 237
GLY A 264
ASP A  42
SER A 273
 None
None
MG  A 401 (-2.5A)
None
 1.13A 4rfqA-2cw6A:
undetectable		 4rfqA-2cw6A:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e5v L-ASPARTATE OXIDASE

(Sulfurisphaera
tokodaii) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		4 THR A 184
GLY A 190
ASP A 191
SER A 176
 FAD  A1002 ( 4.4A)
None
FAD  A1002 (-2.9A)
None
 1.28A 4rfqA-2e5vA:
2.2		 4rfqA-2e5vA:
21.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o39 FIBER PROTEIN

(Human
mastadenovirus
B) 		PF00541
(Adeno_knob) 		4 THR A 239
GLY A 234
ASP A 325
SER A 238
 None
 1.35A 4rfqA-2o39A:
undetectable		 4rfqA-2o39A:
19.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pm9 PROTEIN TRANSPORT
PROTEIN SEC31

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		4 THR A 306
GLY A 277
ASP A 279
SER A 262
 None
 0.97A 4rfqA-2pm9A:
undetectable		 4rfqA-2pm9A:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qe8 UNCHARACTERIZED
PROTEIN

(Trichormus
variabilis) 		PF03022
(MRJP) 		4 THR A 115
GLY A  85
ASP A  83
SER A 119
 None
 1.38A 4rfqA-2qe8A:
undetectable		 4rfqA-2qe8A:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qyv XAA-HIS DIPEPTIDASE

(Histophilus
somni) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 THR A 345
GLY A 183
ASP A 396
SER A 367
 None
 1.34A 4rfqA-2qyvA:
undetectable		 4rfqA-2qyvA:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vjh PHYCOERYTHRIN ALPHA
CHAIN

(Gloeobacter
violaceus) 		PF00502
(Phycobilisome) 		4 THR A   6
GLY A 103
ASP A 106
SER A   3
 None
 1.26A 4rfqA-2vjhA:
undetectable		 4rfqA-2vjhA:
19.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w37 ORNITHINE
CARBAMOYLTRANSFERASE
, CATABOLIC

(Lactobacillus
hilgardii) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		4 THR A  63
GLY A  84
ASP A  87
SER A  61
 None
 1.21A 4rfqA-2w37A:
2.1		 4rfqA-2w37A:
23.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wn4 ADP-RIBOSYLTRANSFERA
SE ENZYMATIC
COMPONENT

(Clostridioides
difficile) 		PF03496
(ADPrib_exo_Tox) 		4 THR A 366
GLY A 189
ASP A 141
SER A 217
 None
 1.38A 4rfqA-2wn4A:
undetectable		 4rfqA-2wn4A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2y6g XYLANASE

(Rhodothermus
marinus) 		PF02018
(CBM_4_9) 		4 THR A  13
GLY A   9
ASP A 160
SER A  12
 None
CA  A1169 (-3.6A)
CA  A1169 (-2.2A)
None
 1.40A 4rfqA-2y6gA:
undetectable		 4rfqA-2y6gA:
23.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yg6 PUTRESCINE OXIDASE

(Rhodococcus
erythropolis) 		PF01593
(Amino_oxidase) 		4 THR A 314
GLY A 102
ASP A 103
SER A  88
 None
 1.39A 4rfqA-2yg6A:
undetectable		 4rfqA-2yg6A:
19.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ywb GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG]

(Thermus
thermophilus) 		PF00117
(GATase)
PF00958
(GMP_synt_C) 		4 THR A  12
GLY A  31
ASP A  32
SER A  49
 None
 1.33A 4rfqA-2ywbA:
2.5		 4rfqA-2ywbA:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a3h ENDOGLUCANASE

(Salipaludibacillus
agaradhaerens) 		PF00150
(Cellulase) 		4 THR A 265
GLY A 236
ASP A 237
SER A 263
 None
CTR  A   1 (-3.5A)
None
None
 1.34A 4rfqA-3a3hA:
undetectable		 4rfqA-3a3hA:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ce1 SUPEROXIDE DISMUTASE
[CU-ZN]

(Naganishia
liquefaciens) 		PF00080
(Sod_Cu) 		4 THR A 133
GLY A  76
ASP A  77
SER A 138
 None
 1.33A 4rfqA-3ce1A:
undetectable		 4rfqA-3ce1A:
17.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3csk PROBABLE
DIPEPTIDYL-PEPTIDASE
3

(Saccharomyces
cerevisiae) 		PF03571
(Peptidase_M49) 		4 THR A 496
GLY A 488
ASP A 490
SER A 640
 None
MG  A 714 ( 4.9A)
MG  A 714 (-3.6A)
None
 1.40A 4rfqA-3cskA:
undetectable		 4rfqA-3cskA:
19.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dwk PENICILLIN-BINDING
PROTEIN 2

(Staphylococcus
aureus) 		PF00905
(Transpeptidase)
PF00912
(Transgly) 		4 THR A 520
GLY A 370
ASP A 366
SER A 544
 None
 1.37A 4rfqA-3dwkA:
undetectable		 4rfqA-3dwkA:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gq9 PRENECK APPENDAGE
PROTEIN

(Bacillus virus
phi29) 		PF11962
(Peptidase_G2)
PF12708
(Pectate_lyase_3) 		4 THR A 451
GLY A 507
ASP A 506
SER A 482
 None
 1.25A 4rfqA-3gq9A:
undetectable		 4rfqA-3gq9A:
19.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3heb RESPONSE REGULATOR
RECEIVER DOMAIN
PROTEIN (CHEY)

(Rhodospirillum
rubrum) 		PF00072
(Response_reg) 		4 THR A  90
GLY A  51
ASP A  53
SER A  59
 None
 1.36A 4rfqA-3hebA:
undetectable		 4rfqA-3hebA:
20.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hjr EXTRACELLULAR SERINE
PROTEASE

(Aeromonas
sobria) 		PF00082
(Peptidase_S8)
PF01483
(P_proprotein) 		4 THR A 339
GLY A 179
ASP A 247
SER A 177
 None
 1.06A 4rfqA-3hjrA:
1.6		 4rfqA-3hjrA:
21.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i3l ALKYLHALIDASE CMLS

(Streptomyces
venezuelae) 		PF04820
(Trp_halogenase) 		4 THR A  86
GLY A 204
ASP A 196
SER A  73
 None
 1.40A 4rfqA-3i3lA:
3.2		 4rfqA-3i3lA:
20.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ka7 OXIDOREDUCTASE

(Methanosarcina
mazei) 		PF01593
(Amino_oxidase) 		4 THR A 253
GLY A 398
ASP A 399
SER A 246
 None
FAD  A 500 (-3.2A)
FAD  A 500 (-3.6A)
None
 0.98A 4rfqA-3ka7A:
3.2		 4rfqA-3ka7A:
22.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lk6 LIPOPROTEIN YBBD

(Bacillus
subtilis) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C) 		4 THR A 200
GLY A 227
ASP A 228
SER A 192
 None
 1.24A 4rfqA-3lk6A:
undetectable		 4rfqA-3lk6A:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ng3 DEOXYRIBOSE-PHOSPHAT
E ALDOLASE

(Mycobacterium
avium) 		PF01791
(DeoC) 		4 THR A 159
GLY A 192
ASP A 198
SER A 160
 None
None
CL  A 224 ( 4.7A)
None
 1.24A 4rfqA-3ng3A:
undetectable		 4rfqA-3ng3A:
22.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oib ACYL-COA
DEHYDROGENASE

(Mycolicibacterium
smegmatis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 THR A 180
GLY A 104
ASP A 377
SER A 109
 FDA  A 518 (-3.9A)
None
None
None
 0.92A 4rfqA-3oibA:
undetectable		 4rfqA-3oibA:
23.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3on6 UNCHARACTERIZED
PROTEIN

(Bacteroides
ovatus) 		PF06824
(Glyco_hydro_125) 		4 THR A 450
GLY A 393
ASP A 346
SER A 440
 None
 1.34A 4rfqA-3on6A:
undetectable		 4rfqA-3on6A:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p2c PUTATIVE GLYCOSYL
HYDROLASE

(Bacteroides
ovatus) 		PF06824
(Glyco_hydro_125) 		4 THR A 456
GLY A 399
ASP A 352
SER A 446
 None
 1.37A 4rfqA-3p2cA:
undetectable		 4rfqA-3p2cA:
21.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pig BETA-FRUCTOFURANOSID
ASE

(Bifidobacterium
longum) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		4 THR A 418
GLY A 439
ASP A 440
SER A 484
 None
 1.22A 4rfqA-3pigA:
undetectable		 4rfqA-3pigA:
17.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q3q ALKALINE PHOSPHATASE

(Sphingomonas
sp. BSAR-1) 		PF01663
(Phosphodiest) 		4 THR A 490
GLY A 395
ASP A 394
SER A 478
 None
 1.30A 4rfqA-3q3qA:
undetectable		 4rfqA-3q3qA:
18.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rg1 CD180 MOLECULE

(Bos taurus) 		PF00560
(LRR_1)
PF13855
(LRR_8) 		4 THR A 459
GLY A 484
ASP A 483
SER A 480
 None
 1.39A 4rfqA-3rg1A:
undetectable		 4rfqA-3rg1A:
18.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tgh GLIDEOSOME-ASSOCIATE
D PROTEIN 50

(Plasmodium
falciparum) 		PF00149
(Metallophos) 		4 THR A 105
GLY A 255
ASP A 257
SER A  66
 None
 1.26A 4rfqA-3tghA:
undetectable		 4rfqA-3tghA:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u1k POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE 1, MITOCHONDRIAL

(Homo sapiens) 		PF00013
(KH_1)
PF01138
(RNase_PH)
PF03725
(RNase_PH_C)
PF03726
(PNPase) 		4 THR A 434
GLY A 535
ASP A 538
SER A 479
 None
None
CIT  A 670 (-3.4A)
CIT  A   1 ( 4.4A)
 1.32A 4rfqA-3u1kA:
undetectable		 4rfqA-3u1kA:
19.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v57 PHYCOERYTHRIN ALPHA
SUBUNIT

(Porphyridium
purpureum) 		PF00502
(Phycobilisome) 		4 THR A   6
GLY A 103
ASP A 106
SER A   3
 None
 1.26A 4rfqA-3v57A:
undetectable		 4rfqA-3v57A:
24.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w36 NAPH1

(Streptomyces
sp. CNQ525) 		no annotation 4 THR A 481
GLY A 510
ASP A 511
SER A 435
 None
 1.16A 4rfqA-3w36A:
undetectable		 4rfqA-3w36A:
19.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE

(Parageobacillus
thermoglucosidasius) 		PF00465
(Fe-ADH) 		4 THR A 614
GLY A 608
ASP A 661
SER A 611
 None
None
ZN  A1870 ( 1.7A)
None
 1.34A 4rfqA-3zdrA:
2.9		 4rfqA-3zdrA:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zyj LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 4C

(Homo sapiens) 		PF00560
(LRR_1)
PF07679
(I-set)
PF13306
(LRR_5)
PF13855
(LRR_8) 		4 THR A  76
GLY A  73
ASP A  72
SER A  75
 None
 1.30A 4rfqA-3zyjA:
undetectable		 4rfqA-3zyjA:
19.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bzk PROTEIN TRANSPORT
PROTEIN SEC31

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF12931
(Sec16_C) 		4 THR A 306
GLY A 277
ASP A 279
SER A 262
 None
 0.97A 4rfqA-4bzkA:
undetectable		 4rfqA-4bzkA:
12.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4e1j GLYCEROL KINASE

(Sinorhizobium
meliloti) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		4 THR A 310
GLY A 265
ASP A 266
SER A 209
 None
None
GOL  A 601 (-2.7A)
None
 1.14A 4rfqA-4e1jA:
undetectable		 4rfqA-4e1jA:
19.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4euo ABC TRANSPORTER,
SUBSTRATE BINDING
PROTEIN (POLYAMINE)

(Agrobacterium
fabrum) 		PF13416
(SBP_bac_8) 		4 THR A 114
GLY A  83
ASP A  84
SER A 117
 None
 1.30A 4rfqA-4euoA:
undetectable		 4rfqA-4euoA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f40 PROSTAGLANDIN
F2-ALPHA
SYNTHASE/D-ARABINOSE
DEHYDROGENASE

(Leishmania
major) 		PF00248
(Aldo_ket_red) 		4 THR A  33
GLY A  23
ASP A  49
SER A  27
 None
 1.19A 4rfqA-4f40A:
undetectable		 4rfqA-4f40A:
21.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fmr UNCHARACTERIZED
HYPOTHETICAL PROTEIN

(Bacteroides
vulgatus) 		PF14734
(DUF4469)
PF14848
(HU-DNA_bdg) 		4 THR A 179
GLY A 209
ASP A 208
SER A 176
 None
 1.13A 4rfqA-4fmrA:
undetectable		 4rfqA-4fmrA:
22.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gd5 PHOSPHATE ABC
TRANSPORTER,
PHOSPHATE-BINDING
PROTEIN

(Clostridium
perfringens) 		PF12849
(PBP_like_2) 		4 THR A 161
GLY A 185
ASP A 184
SER A  43
 PO4  A 301 (-3.6A)
None
None
PO4  A 301 (-2.7A)
 1.40A 4rfqA-4gd5A:
undetectable		 4rfqA-4gd5A:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gfi MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Agrobacterium
fabrum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 THR A 230
GLY A 251
ASP A  93
SER A 229
 None
 1.22A 4rfqA-4gfiA:
undetectable		 4rfqA-4gfiA:
20.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i7z APOCYTOCHROME F

(Mastigocladus
laminosus) 		PF01333
(Apocytochr_F_C)
PF16639
(Apocytochr_F_N) 		4 THR C 181
GLY C 178
ASP C 202
SER C 198
 None
 1.36A 4rfqA-4i7zC:
undetectable		 4rfqA-4i7zC:
21.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lur INTERPHOTORECEPTOR
RETINOID-BINDING
PROTEIN(IRBP)

(Danio rerio) 		PF03572
(Peptidase_S41)
PF11918
(Peptidase_S41_N) 		4 THR A 211
GLY A 232
ASP A 280
SER A 208
 None
 1.39A 4rfqA-4lurA:
undetectable		 4rfqA-4lurA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4n6k TRAP DICARBOXYLATE
TRANSPORTER-DCTP
SUBUNIT

(Desulfovibrio
salexigens) 		PF03480
(DctP) 		4 THR A 218
GLY A 240
ASP A  95
SER A 215
 X3X  A 401 (-2.7A)
None
X3X  A 401 (-3.6A)
None
 1.27A 4rfqA-4n6kA:
undetectable		 4rfqA-4n6kA:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nx1 C4-DICARBOXYLATE
TRANSPORT SYSTEM
SUBSTRATE-BINDING
PROTEIN

(Sulfitobacter
sp. NAS-14.1) 		PF03480
(DctP) 		4 THR A  44
GLY A  33
ASP A  65
SER A  35
 None
 1.09A 4rfqA-4nx1A:
undetectable		 4rfqA-4nx1A:
22.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p5i CHEMOKINE BINDING
PROTEIN

(Orf virus) 		PF02250
(Orthopox_35kD) 		4 THR A  73
GLY A 149
ASP A 151
SER A  82
 None
NAG  A 301 ( 4.3A)
NAG  A 301 (-3.5A)
NAG  A 301 ( 4.9A)
 1.31A 4rfqA-4p5iA:
undetectable		 4rfqA-4p5iA:
24.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q8r PHOSPHATE ABC
TRANSPORTER,
PHOSPHATE-BINDING
PROTEIN

(Clostridium
perfringens) 		PF12849
(PBP_like_2) 		4 THR A 131
GLY A 155
ASP A 154
SER A  13
 PO4  A 301 (-3.6A)
None
None
PO4  A 301 (-2.6A)
 1.36A 4rfqA-4q8rA:
undetectable		 4rfqA-4q8rA:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r04 TOXIN A

(Clostridioides
difficile) 		PF11713
(Peptidase_C80)
PF12918
(TcdB_N)
PF12919
(TcdA_TcdB)
PF12920
(TcdA_TcdB_pore) 		4 THR A1523
GLY A1526
ASP A1512
SER A1541
 None
 1.13A 4rfqA-4r04A:
undetectable		 4rfqA-4r04A:
9.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4rfq HISTIDINE PROTEIN
METHYLTRANSFERASE 1
HOMOLOG

(Homo sapiens) 		PF13489
(Methyltransf_23) 		4 THR A 172
GLY A 195
ASP A 217
SER A 293
 SAM  A 401 (-3.7A)
SAM  A 401 (-3.0A)
SAM  A 401 (-3.0A)
SAM  A 401 (-2.8A)
 0.00A 4rfqA-4rfqA:
49.6		 4rfqA-4rfqA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rnr PGT130 LIGHT CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 THR B  26
GLY B  93
ASP B  95
SER B  27
 None
 1.37A 4rfqA-4rnrB:
undetectable		 4rfqA-4rnrB:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uou FUCOSE-SPECIFIC
LECTIN FLEA

(Aspergillus
fumigatus) 		PF07938
(Fungal_lectin) 		4 THR A  76
GLY A  33
ASP A  30
SER A  60
 None
 1.36A 4rfqA-4uouA:
undetectable		 4rfqA-4uouA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xa8 D-ISOMER SPECIFIC
2-HYDROXYACID
DEHYDROGENASE
NAD-BINDING

(Xanthobacter
autotrophicus) 		PF02826
(2-Hacid_dh_C) 		4 THR A 175
GLY A 152
ASP A 153
SER A 173
 None
 1.24A 4rfqA-4xa8A:
5.1		 4rfqA-4xa8A:
21.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zoh PUTATIVE
OXIDOREDUCTASE
MOLYBDOPTERIN-BINDIN
G SUBUNIT

(Sulfurisphaera
tokodaii) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		4 THR A 681
GLY A 569
ASP A 592
SER A 409
 None
 1.00A 4rfqA-4zohA:
undetectable		 4rfqA-4zohA:
19.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5b13 PHYCOERYTHRIN ALPHA
SUBUNIT

(Palmaria
palmata) 		PF00502
(Phycobilisome) 		4 THR A   6
GLY A 103
ASP A 106
SER A   3
 None
 1.29A 4rfqA-5b13A:
undetectable		 4rfqA-5b13A:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bq1 CARBONIC ANHYDRASE

(Pseudomonas
aeruginosa) 		PF00484
(Pro_CA) 		4 THR A 195
GLY A 198
ASP A 200
SER A 176
 None
 1.35A 4rfqA-5bq1A:
undetectable		 4rfqA-5bq1A:
20.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dbt DEOXYRIBOSE-PHOSPHAT
E ALDOLASE

(Streptococcus
suis) 		PF01791
(DeoC) 		4 THR A 152
GLY A 184
ASP A 190
SER A 153
 None
 1.38A 4rfqA-5dbtA:
undetectable		 4rfqA-5dbtA:
23.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ecu CELLULASE

(Caldicellulosiruptor
saccharolyticus) 		PF00150
(Cellulase)
PF03424
(CBM_17_28) 		4 THR A 322
GLY A 293
ASP A 294
SER A 320
 None
EDO  A 614 (-3.6A)
None
None
 1.26A 4rfqA-5ecuA:
undetectable		 4rfqA-5ecuA:
18.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h7w VENOM
5'-NUCLEOTIDASE

(Naja atra) 		no annotation 4 THR A 178
GLY A 242
ASP A  37
SER A 221
 None
None
ZN  A 605 ( 3.1A)
None
 1.37A 4rfqA-5h7wA:
undetectable		 4rfqA-5h7wA:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hqb ALPHA-GLUCOSIDASE

(Pseudoalteromonas
sp. K8) 		PF10566
(Glyco_hydro_97)
PF14508
(GH97_N)
PF14509
(GH97_C) 		4 THR A 192
GLY A 253
ASP A 258
SER A 202
 None
 1.40A 4rfqA-5hqbA:
undetectable		 4rfqA-5hqbA:
18.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5iml NANOBODY

(Camelidae) 		PF07686
(V-set) 		4 THR B  27
GLY B  98
ASP B 112
SER B  30
 None
 0.89A 4rfqA-5imlB:
undetectable		 4rfqA-5imlB:
17.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5iy6 TFIIH BASAL
TRANSCRIPTION FACTOR
COMPLEX HELICASE XPB
SUBUNIT

(Homo sapiens) 		PF04851
(ResIII)
PF16203
(ERCC3_RAD25_C) 		4 THR V 469
GLY V 630
ASP V 563
SER V 632
 None
 1.39A 4rfqA-5iy6V:
2.7		 4rfqA-5iy6V:
17.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lq3 CMEB

(Campylobacter
jejuni) 		PF00873
(ACR_tran) 		4 THR A  43
GLY A 174
ASP A 175
SER A 297
 None
 1.18A 4rfqA-5lq3A:
undetectable		 4rfqA-5lq3A:
15.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ly8 TAIL COMPONENT

(Lactobacillus
phage J-1) 		no annotation 4 THR A  30
GLY A 208
ASP A 207
SER A  79
 None
 0.71A 4rfqA-5ly8A:
undetectable		 4rfqA-5ly8A:
18.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nb3 PHYCOERYTHRIN ALPHA
SUBUNIT,PHYCOERYTHRI
N ALPHA
SUBUNIT,PHYCOERYTHRI
N ALPHA SUBUNIT

(Phormidium
rubidum) 		PF00502
(Phycobilisome) 		4 THR A   6
GLY A 103
ASP A 106
SER A   3
 None
 1.24A 4rfqA-5nb3A:
undetectable		 4rfqA-5nb3A:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tuj ANCESTRAL PROTEIN
CDT-ANC1

(unidentified) 		no annotation 4 THR C  15
GLY C 216
ASP C 101
SER C  14
 None
 1.39A 4rfqA-5tujC:
undetectable		 4rfqA-5tujC:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ue0 CT622 PROTEIN

(Chlamydia
trachomatis) 		no annotation 4 THR A 397
GLY A 405
ASP A 407
SER A 400
 None
 1.31A 4rfqA-5ue0A:
undetectable		 4rfqA-5ue0A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v41 POLYKETIDE SYNTHASE
PKS13 (TERMINATION
POLYKETIDE SYNTHASE)

(Mycobacterium
tuberculosis) 		PF00975
(Thioesterase) 		4 THR A1481
GLY A1478
ASP A1639
SER A1480
 None
 1.22A 4rfqA-5v41A:
3.1		 4rfqA-5v41A:
22.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v9x ATP-DEPENDENT DNA
HELICASE

(Mycolicibacterium
smegmatis) 		no annotation 4 THR A  16
GLY A  10
ASP A   7
SER A  13
 None
 1.18A 4rfqA-5v9xA:
2.6		 4rfqA-5v9xA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5win -

(-) 		no annotation 4 THR A 705
GLY A 672
ASP A 735
SER A 703
 None
 1.08A 4rfqA-5winA:
undetectable		 4rfqA-5winA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xoe ATP-DEPENDENT
6-PHOSPHOFRUCTOKINAS
E

(Staphylococcus
aureus) 		no annotation 4 THR A   8
GLY A  43
ASP A  48
SER A  70
 None
 1.38A 4rfqA-5xoeA:
undetectable		 4rfqA-5xoeA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yvs ALCOHOL
DEHYDROGENASE

(candidate
divison MSBL1
archaeon
SCGC-AAA259E19) 		no annotation 4 THR A 157
GLY A 151
ASP A 204
SER A 154
 NDP  A 502 (-2.5A)
None
MN  A 501 ( 2.3A)
NDP  A 502 (-3.6A)
 1.37A 4rfqA-5yvsA:
2.2		 4rfqA-5yvsA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cvz E3 UBIQUITIN-PROTEIN
LIGASE RFWD3

(Homo sapiens) 		no annotation 4 THR A 643
GLY A 606
ASP A 550
SER A 592
 None
 1.39A 4rfqA-6cvzA:
undetectable		 4rfqA-6cvzA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6elq CARBON MONOXIDE
DEHYDROGENASE

(Carboxydothermus
hydrogenoformans) 		no annotation 4 THR X 227
GLY X 219
ASP X 218
SER X 529
 None
 1.24A 4rfqA-6elqX:
undetectable		 4rfqA-6elqX:
undetectable